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Substance Name: Phenol, 3-(3-(4-methyl-1-phenethyl-3-propylpiperidinyl))-, oxalate
RN: 6604-67-7
InChIKey: FWBFZJFFWQUNLR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N-O.C2-H2-O4

Molecular Weight

  • 427.538
 
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Names and Synonyms

Synonyms

  • 3-(3-(4-Methyl-1-phenethyl-3-propylpiperidinyl))phenol, oxalate
  • 3-(p-Hydroxyphenyl)-4-methyl-1-phenethyl-3-propylpiperidine, oxolate
  • Piperidine, 3-(p-hydroxyphenyl)-4-methyl-1-phenethyl-3-propyl-, oxolate

Systematic Name

  • Phenol, 3-(3-(4-methyl-1-phenethyl-3-propylpiperidinyl))-, oxalate

Registry Numbers

CAS Registry Number

  • 6604-67-7

System Generated Number

  • 0006604677

Molecular Formulas

Molecular Formula

  • C23-H31-N-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C23-H31-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C23H31NO.C2H2O4/c1-3-14-23(21-10-7-11-22(25)17-21)18-24(15-12-19(23)2)16-13-20-8-5-4-6-9-20;3-1(4)2(5)6/h4-11,17,19,25H,3,12-16,18H2,1-2H3;(H,3,4)(H,5,6)

InChIKey

FWBFZJFFWQUNLR-UHFFFAOYSA-N

Smiles

c1(O)cc([C@@]2([C@@H](CC[N@@](CCc3ccccc3)C2)C)CCC)ccc1.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 208mg/kg (208mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 298, 1964.